N-Benzyl-4-(furan-2-yl)-N,N-dimethylbutan-1-aminium iodide

HCID 44513

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Basic information

CAS: 63446-12-8
Standard SMILES: C[N+](C)(CCCCc1ccco1)Cc1ccccc1.[I-]
InChIKey: MVRQHJBUFFCHFO-UHFFFAOYSA-M
Molecular formula: C17H24INO
Average molar mass: 385.28 g/mol
Monoisotopic mass: 385.09026

Names & identifiers

Preferred name: N-Benzyl-4-(furan-2-yl)-N,N-dimethylbutan-1-aminium iodide
IUPAC: benzyl-[4-(furan-2-yl)butyl]-dimethylazanium iodide

Names & synonyms

63446-12-8DTXSID80979649N-Benzyl-4-(furan-2-yl)-N,N-dimethylbutan-1-aminium iodideRefChem:1091590DTXCID201406940Benzyldimethyl(4-(2-furyl)butyl)ammonium iodideAMMONIUM, BENZYLDIMETHYL(4-(2-FURYL)BUTYL)-, IODIDE

Database identifiers

CAS: 63446-12-8
PubChem CID: 44513
DTXSID: DTXSID80979649

Properties

Computed structural properties

Topological polar surface area: 13.1 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 7
Heavy atoms: 20
Formal charge: 0
Complexity: 246

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